▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
MnAsPd | ICSD | 610909 | P-62m (189) | ✗ | 9 | 90 | 3 | 0.0 | 0.000 | 0.659 | ? | ✗ | 06/10/16 |
HfSi | ICSD | 53040 | Pnma (62) | ✔ | 8 | 64 | 3 | 0.0 | 0.046 | 0.093 | (1;000) | ✗ | 27/01/17 |
HfSi2 | ICSD | 16697 | Cmcm (63) | ✔ | 6 | 40 | 3 | 0.0 | 0.025 | 0.327 | (1;000) | ✗ | 06/10/16 |
ZrTe | ICSD | 410867 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.093 | (1;100) | ✔ | 04/10/16 |
Hf3Sc | ICSD | 168284 | Ccmm (63) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.590 | (1;110) | ✗ | 06/10/16 |
Hf5Te4 | ICSD | 154358 | I4/m (87) | ✔ | 9 | 84 | 3 | 0.0 | 0.001 | 0.544 | (1;111) | ✗ | 02/02/17 |
KHg | ICSD | 104302 | P-1 (2) | ✔ | 8 | 84 | 3 | 0.0 | 0.028 | 0.152 | (0;010) | ✗ | 06/10/16 |
NaHg | ICSD | 104326 | Ccmm (63) | ✔ | 8 | 84 | 3 | 0.0 | 0.014 | 0.562 | (0;000) | ✗ | 06/10/16 |
HgTe | ICSD | 162604 | Ccmm (63) | ✔ | 4 | 36 | 3 | 0.0 | 0.055 | 0.417 | (0;110) | ✗ | 06/10/16 |
NiHg4 | ICSD | 151197 | Im-3m (229) | ✔ | 5 | 58 | 3 | 0.0 | 0.120 | 0.417 | (0;000) | ✗ | 27/01/17 |
Hg4Pt | ICSD | 639148 | Im-3m (229) | ✔ | 5 | 58 | 3 | 0.0 | 0.659 | 0.309 | (0;000) | ✗ | 27/01/17 |
SbRu | ICSD | 990 | Pmnb (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.549 | (0;011) | ✗ | 06/10/16 |
SiRh | ICSD | 108722 | Pmnb (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.174 | (0;011) | ✗ | 06/10/16 |
MnAsPd | ICSD | 610906 | P-62m (189) | ✗ | 9 | 90 | 3 | 0.0 | 0.000 | 0.655 | ? | ✗ | 06/10/16 |
CuN | ICSD | 161756 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.009 | 0.871 | (0;000) | ✔ | 06/10/16 |
SrZn | ICSD | 54980 | Pmnb (62) | ✔ | 8 | 88 | 1 | 0.0 | 0.008 | 0.518 | (1;000) | ✗ | 06/10/16 |
CrS2 | ICSD | 75420 | C2/m (12) | ✔ | 3 | 26 | 2 | 0.0 | 0.051 | 0.157 | (0;100) | ✔ | 04/10/16 |
VRh | ICSD | 169386 | Cmmm (65) | ✔ | 4 | 60 | 3 | 0.0 | 0.013 | 0.551 | (0;111) | ✗ | 27/01/17 |
C3N4 | ICSD | 248430 | P-6 (174) | ✗ | 7 | 32 | 1 | 0.0 | 0.001 | 0.871 | (0;000) | ✔ | 06/10/16 |
MnAsRu | ICSD | 601489 | P-62m (189) | ✗ | 9 | 108 | 3 | 0.0 | 0.000 | 0.404 | ? | ✗ | 06/10/16 |
NbI5 | ICSD | 10457 | P-1 (2) | ✔ | 12 | 96 | 1 | 0.0 | 0.048 | 0.113 | (0;111) | ✗ | 06/10/16 |
Li2In | ICSD | 51961 | Cmcm (63) | ✔ | 6 | 38 | 1 | 0.0 | 0.000 | 0.804 | (1;110) | ✗ | 27/01/17 |
BeAu | ICSD | 58396 | P2_13 (198) | ✗ | 8 | 60 | 3 | 0.0 | 0.000 | 0.475 | (1;111) | ✔ | 06/10/16 |
InSb | ICSD | 156995 | Cmcm (63) | ✔ | 4 | 36 | 3 | 0.0 | 0.022 | 0.498 | (0;000) | ✗ | 06/10/16 |
MoIr | ICSD | 104499 | Pmmb (51) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.815 | (0;001) | ✗ | 06/10/16 |
IrN2 | ICSD | 160620 | Pmnn (58) | ✔ | 6 | 38 | 3 | 0.0 | 0.000 | 0.965 | (1;011) | ✗ | 06/10/16 |
SiIr | ICSD | 15693 | Pmnb (62) | ✔ | 8 | 52 | 3 | 0.0 | 0.001 | 0.343 | (0;011) | ✗ | 06/10/16 |
VIr | ICSD | 104590 | Cmmm (65) | ✔ | 4 | 44 | 3 | 0.0 | 0.012 | 0.614 | (0;111) | ✗ | 06/10/16 |
IrW | ICSD | 104596 | Pmmb (51) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.746 | (0;001) | ✗ | 06/10/16 |
ZrIr | ICSD | 163453 | Cmcm (63) | ✔ | 8 | 84 | 3 | 0.0 | 0.017 | 0.492 | (1;000) | ✗ | 27/01/17 |
CrBr2 | ICSD | 23903 | C2/m (12) | ✔ | 3 | 28 | 2 | 0.0 | 0.045 | 0.565 | (0;000) | ✔ | 27/01/17 |
YSn2 | ICSD | 416771 | Cmcm (63) | ✔ | 6 | 78 | 3 | 0.0 | 0.000 | 0.768 | (0;000) | ✗ | 27/01/17 |
LaNi | ICSD | 641489 | Ccmm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.851 | (1;110) | ✗ | 06/10/16 |
LaPd | ICSD | 641672 | Ccmm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.854 | (0;110) | ✗ | 06/10/16 |
LaPt | ICSD | 641688 | Ccmm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.831 | (0;110) | ✗ | 06/10/16 |
LaRh | ICSD | 641721 | Ccmm (63) | ✔ | 4 | 40 | 3 | 0.0 | 0.011 | 0.109 | (0;000) | ✗ | 06/10/16 |
LaS | ICSD | 77831 | Ccme (64) | ✔ | 8 | 36 | 2 | 0.0 | 0.000 | 0.635 | (1;000) | ✗ | 06/10/16 |
LaSi | ICSD | 408030 | Ccmm (63) | ✔ | 8 | 28 | 3 | 0.0 | 0.019 | 0.484 | (0;000) | ✗ | 06/10/16 |
LaSn | ICSD | 423421 | Cmcm (63) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.738 | (0;000) | ✗ | 06/10/16 |
LaSn2 | ICSD | 657383 | Cmmm (65) | ✔ | 6 | 62 | 3 | 0.0 | 0.011 | 0.391 | (1;000) | ✗ | 06/10/16 |
LaTe3 | ICSD | 642014 | Ccmm (63) | ✔ | 8 | 42 | 2 | 0.0 | 0.000 | 0.968 | (1;000) | ✗ | 06/10/16 |
ZrTe | ICSD | 280620 | Pmnb (62) | ✔ | 8 | 72 | 3 | 0.0 | 0.014 | 0.144 | (0;000) | ✗ | 06/10/16 |
AuN | ICSD | 167882 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.000 | 0.871 | (0;000) | ✔ | 06/10/16 |
Li2Tl | ICSD | 642401 | Cmcm (63) | ✔ | 6 | 38 | 1 | 0.0 | 0.000 | 0.717 | (1;110) | ✗ | 27/01/17 |
Mg3Sn | ICSD | 70069 | P-1 (2) | ✔ | 8 | 88 | 3 | 0.0 | 0.000 | 0.622 | (1;001) | ✗ | 06/10/16 |
MnO2 | ICSD | 20227 | I4/m (87) | ✔ | 12 | 108 | 3 | 0.0 | 0.001 | 0.936 | (1;000) | ✗ | 06/10/16 |
MnP | ICSD | 30412 | Pmnb (62) | ✔ | 8 | 80 | 3 | 0.0 | 0.004 | 0.259 | (1;000) | ✗ | 06/10/16 |
AuSe | ICSD | 73669 | C2/m (12) | ✔ | 4 | 34 | 2 | 0.0 | 0.719 | 0.042 | (0;000) | ✔ | 06/10/16 |
MnS2 | ICSD | 643441 | Pnnm (58) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.914 | (0;101) | ✗ | 27/01/17 |
MnTe | ICSD | 643799 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.702 | (0;011) | ✗ | 27/01/17 |
MoN | ICSD | 76280 | P6_3/mmc (194) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.939 | (0;000) | ✗ | 06/10/16 |
Ni4Mo | ICSD | 105047 | I4/m (87) | ✔ | 5 | 54 | 3 | 0.0 | 0.001 | 0.721 | (1;000) | ✗ | 06/10/16 |
MoPt | ICSD | 644148 | Pmmb (51) | ✔ | 4 | 48 | 3 | 0.0 | 0.067 | 0.517 | (0;101) | ✗ | 06/10/16 |
MoRh | ICSD | 108608 | Pmma (51) | ✔ | 4 | 62 | 3 | 0.0 | 0.000 | 0.802 | (0;001) | ✗ | 27/01/17 |
Ba | ICSD | 615773 | P6_3/mmc (194) | ✔ | 2 | 20 | 1 | 0.0 | 0.019 | 0.268 | (0;000) | ✗ | 05/01/17 |
LiB11 | ICSD | 164842 | R3m (160) | ✗ | 12 | 36 | 0 | 0.0 | 0.261 | 0.254 | (0;000) | ✔ | 06/10/16 |
MoS2 | ICSD | 26622 | R-3m (166) | ✔ | 3 | 26 | 2 | 0.0 | 0.053 | 0.331 | (1;111) | ✗ | 27/01/17 |
Te2Mo | ICSD | 14349 | P2_1/m (11) | ✔ | 12 | 104 | 2 | 0.0 | 0.034 | 0.170 | (0;000) | ✗ | 06/10/16 |
Pd2N | ICSD | 236605 | P4/mmm (123) | ✔ | 6 | 50 | 3 | 0.0 | 0.020 | 0.753 | (0;111) | ✗ | 06/10/16 |
Pd2N | ICSD | 96418 | Pnnm (58) | ✔ | 6 | 82 | 3 | 0.0 | 0.000 | 0.775 | (1;011) | ✗ | 27/01/17 |
Si2Os | ICSD | 647776 | C2/m (12) | ✔ | 6 | 48 | 3 | 0.0 | 0.447 | 0.105 | (0;000) | ✔ | 27/01/17 |
OsN2 | ICSD | 157283 | Pmnn (58) | ✔ | 6 | 52 | 3 | 0.0 | 0.040 | 0.182 | (0;000) | ✗ | 06/10/16 |
PdN2 | ICSD | 191244 | Pnnm (58) | ✔ | 6 | 40 | 2 | 0.0 | 0.013 | 0.578 | (0;000) | ✗ | 06/10/16 |
BiB | ICSD | 184569 | F-43m (216) | ✗ | 2 | 8 | 3 | 0.0 | 0.000 | 0.008 | (1;000) | ✔ | 06/10/16 |
ReN2 | ICSD | 187452 | Cmmm (65) | ✔ | 6 | 50 | 3 | 0.0 | 0.024 | 0.517 | (0;001) | ✗ | 06/10/16 |
RhN2 | ICSD | 160622 | Pmnn (58) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.983 | (1;011) | ✗ | 06/10/16 |
YMgAg | ICSD | 104477 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.002 | 0.929 | ? | ✗ | 06/10/16 |
RuN2 | ICSD | 240754 | Pmnn (58) | ✔ | 6 | 52 | 3 | 0.0 | 0.037 | 0.341 | (0;000) | ✗ | 06/10/16 |
NaO2 | ICSD | 180562 | Pmnn (58) | ✔ | 6 | 42 | 1 | 0.0 | 0.000 | 0.985 | (0;110) | ✗ | 06/10/16 |
NaTl | ICSD | 261793 | Cmcm (63) | ✔ | 8 | 88 | 3 | 0.0 | 0.040 | 0.217 | (0;000) | ✗ | 06/10/16 |
NbPt | ICSD | 645211 | Pmma (51) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.803 | (0;101) | ✗ | 27/01/17 |
NbPt3 | ICSD | 645212 | Pmmn (59) | ✔ | 8 | 86 | 3 | 0.0 | 0.000 | 0.825 | (0;000) | ✗ | 27/01/17 |
NbRh | ICSD | 105212 | Pmmb (51) | ✔ | 4 | 60 | 3 | 0.0 | 0.004 | 0.545 | (0;001) | ✗ | 06/10/16 |
NbTe4 | ICSD | 645526 | P4/mcc (124) | ✔ | 10 | 74 | 3 | 0.0 | 0.000 | 0.577 | (1;110) | ✗ | 06/10/16 |
NiS2 | ICSD | 169570 | Pmnn (58) | ✔ | 6 | 44 | 3 | 0.0 | 0.038 | 0.596 | (1;000) | ✗ | 06/10/16 |
NiS2 | ICSD | 169574 | I4/mmm (139) | ✔ | 3 | 22 | 3 | 0.0 | 0.004 | 0.793 | (0;000) | ✗ | 06/10/16 |
NiSb2 | ICSD | 41728 | Pmnn (58) | ✔ | 6 | 40 | 3 | 0.0 | 0.107 | 0.514 | (1;000) | ✗ | 06/10/16 |
TiNi | ICSD | 157606 | Pmmb (51) | ✔ | 4 | 44 | 3 | 0.0 | 0.011 | 0.650 | (0;100) | ✗ | 06/10/16 |
ScAu | COD | 1510291 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.714 | (0;111) | ✗ | 05/01/17 |
ZrNi | ICSD | 105478 | Ccmm (63) | ✔ | 4 | 44 | 3 | 0.0 | 0.007 | 0.409 | (1;000) | ✗ | 06/10/16 |
SiNi2 | ICSD | 105342 | P6_3/mmc (194) | ✔ | 6 | 48 | 3 | 0.0 | 0.004 | 0.711 | (0;000) | ✗ | 06/10/16 |
Ni3Sn | ICSD | 646747 | Pmmn (59) | ✔ | 8 | 88 | 3 | 0.0 | 0.014 | 0.443 | (0;010) | ✗ | 27/01/17 |
Ni4W | ICSD | 105452 | I4/m (87) | ✔ | 5 | 54 | 3 | 0.0 | 0.023 | 0.698 | (1;000) | ✗ | 06/10/16 |
Ti4O5 | ICSD | 174033 | I4/m (87) | ✔ | 9 | 78 | 3 | 0.0 | 0.003 | 0.821 | (1;111) | ✗ | 06/10/16 |
Zn2CuAu | ICSD | 150572 | Pmmn (59) | ✔ | 8 | 92 | 3 | 0.0 | 0.042 | 0.873 | (1;000) | ✗ | 05/01/17 |
CuAsS | ICSD | 23826 | P2_1cn (33) | ✗ | 12 | 88 | 3 | 0.0 | 0.140 | 0.063 | (0;000) | ✔ | 06/10/16 |
Ta4O | ICSD | 76022 | Pmmm (47) | ✔ | 5 | 58 | 3 | 0.0 | 0.040 | 0.441 | (0;111) | ✗ | 27/01/17 |
Al6C3N2 | ICSD | 654993 | R3m (160) | ✗ | 11 | 40 | 3 | 0.0 | 0.000 | 0.475 | (0;000) | ✔ | 06/10/16 |
RuO2 | ICSD | 290495 | Pmnn (58) | ✔ | 6 | 56 | 3 | 0.0 | 0.041 | 0.284 | (0;000) | ✗ | 06/10/16 |
TiPd | ICSD | 167649 | P2_1/m (11) | ✔ | 4 | 44 | 3 | 0.0 | 0.000 | 0.849 | (0;000) | ✔ | 06/10/16 |
SbRh | ICSD | 650244 | Pmnb (62) | ✔ | 8 | 88 | 3 | 0.0 | 0.053 | 0.326 | (0;000) | ✗ | 06/10/16 |
TeO2 | ICSD | 166848 | Ccmm (63) | ✔ | 6 | 36 | 3 | 0.0 | 0.511 | 0.006 | (0;000) | ✗ | 06/10/16 |
VO2 | ICSD | 1501 | P-1 (2) | ✔ | 12 | 100 | 2 | 0.0 | 0.011 | 0.534 | (1;001) | ✗ | 06/10/16 |
TePt | ICSD | 41383 | C2/m (12) | ✔ | 4 | 32 | 2 | 0.0 | 0.077 | 0.748 | (1;111) | ✔ | 06/10/16 |
Te4Pt3 | ICSD | 77983 | C2/m (12) | ✔ | 7 | 54 | 3 | 0.0 | 0.070 | 0.458 | (1;001) | ✔ | 27/01/17 |
OsS2 | ICSD | 647750 | Pa3 (205) | ✔ | 12 | 112 | 3 | 0.0 | 0.034 | 0.187 | (1;000) | ✗ | 06/10/16 |
RbSb | ICSD | 191491 | F-43m (216) | ✗ | 2 | 14 | 1 | 0.0 | 0.000 | 0.134 | (0;000) | ✔ | 06/10/16 |
PRu | ICSD | 109139 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.000 | 0.331 | (0;011) | ✗ | 27/01/17 |
PW | ICSD | 42056 | Pmnb (62) | ✔ | 8 | 76 | 3 | 0.0 | 0.003 | 0.392 | (1;011) | ✗ | 06/10/16 |
LiMnSe2 | ICSD | 50817 | P3m1 (156) | ✗ | 4 | 30 | 1 | 0.0 | 0.002 | 0.677 | (1;100) | ✔ | 06/10/16 |